IFLAB-ZINC04315687 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4110 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 2.1650 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 1.5700 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 3.5130 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 4.2610 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 5.7610 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 6.6860 -0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 8.3340 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2870 9.4680 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 9.5170 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 10.5360 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 10.0080 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 8.6730 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7590 11.9710 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 12.9400 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 14.2780 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 14.6610 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4230 13.7040 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 12.3630 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7440 15.9730 0.0240 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -0.6540 -0.0340 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 3.9870 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 4.0000 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 4.0090 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 6.0220 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 6.0130 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 10.5680 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 12.6420 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 15.0280 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4590 14.0080 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 11.6180 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 M END